2-[(3-chlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-chlorophenyl)methylthio]-3-(4-ethoxyphenyl)-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(3-chlorobenzyl)thio]-5,6-dimethyl-3-p-phenetyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H21ClN2O2S2 MolecularWeight: 457.00804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC(=CC=C4)Cl)SC(=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC(=CC=C4)Cl)SC(=C3C)C

InChI

InChI=1S/C23H21ClN2O2S2/c1-4-28-19-10-8-18(9-11-19)26-22(27)20-14(2)15(3)30-21(20)25-23(26)29-13-16-6-5-7-17(24)12-16/h5-12H,4,13H2,1-3H3